F   LATTICE,NONEQUIV.ATOMS   8   43 Fdd2                                       
MODE OF CALC=RELA unit=bohr                                                    
 21.976381 24.282603 41.162393 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.37468000
          MULT= 2          ISPLIT= 8
      -1: X=0.25000000 Y=0.25000000 Z=0.62468000
Hf         NPT=  781  R0=.000005000 RMT= 2.46        Z:  72.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.24119000 Y=0.03086000 Z=0.04401000
          MULT= 4          ISPLIT= 8
      -2: X=0.75881000 Y=0.96914000 Z=0.04401000
      -2: X=0.00881000 Y=0.28086000 Z=0.29401000
      -2: X=0.49119000 Y=0.21914000 Z=0.29401000
Se         NPT=  781  R0=.000050000 RMT= 2.11        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.12021000 Y=0.07828000 Z=0.29475000
          MULT= 4          ISPLIT= 8
      -3: X=0.87979000 Y=0.92172000 Z=0.29475000
      -3: X=0.12979000 Y=0.32828000 Z=0.54475000
      -3: X=0.37021000 Y=0.17172000 Z=0.54475000
Cl         NPT=  781  R0=.000100000 RMT= 1.91        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.13087000 Y=0.59243000 Z=0.12632000
          MULT= 4          ISPLIT= 8
      -4: X=0.86913000 Y=0.40757000 Z=0.12632000
      -4: X=0.11913000 Y=0.84243000 Z=0.37632000
      -4: X=0.38087000 Y=0.65757000 Z=0.37632000
Cl         NPT=  781  R0=.000100000 RMT= 1.91        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.12527000 Y=0.07756000 Z=0.45201000
          MULT= 4          ISPLIT= 8
      -5: X=0.87473000 Y=0.92244000 Z=0.45201000
      -5: X=0.12473000 Y=0.32756000 Z=0.70201000
      -5: X=0.37527000 Y=0.17244000 Z=0.70201000
Cl         NPT=  781  R0=.000100000 RMT= 1.91        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.13839000 Y=0.08350000 Z=0.11987000
          MULT= 4          ISPLIT= 8
      -6: X=0.86161000 Y=0.91650000 Z=0.11987000
      -6: X=0.11161000 Y=0.33350000 Z=0.36987000
      -6: X=0.38839000 Y=0.16650000 Z=0.36987000
Cl         NPT=  781  R0=.000100000 RMT= 1.91        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.13146000 Y=0.34928000 Z=0.04765000
          MULT= 4          ISPLIT= 8
      -7: X=0.86854000 Y=0.65072000 Z=0.04765000
      -7: X=0.11854000 Y=0.59928000 Z=0.29765000
      -7: X=0.38146000 Y=0.90072000 Z=0.29765000
Cl         NPT=  781  R0=.000100000 RMT= 1.91        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.11486000 Y=0.34413000 Z=0.22215000
          MULT= 4          ISPLIT= 8
      -8: X=0.88514000 Y=0.65587000 Z=0.22215000
      -8: X=0.13514000 Y=0.59413000 Z=0.47215000
      -8: X=0.36486000 Y=0.90587000 Z=0.47215000
Cl         NPT=  781  R0=.000100000 RMT= 1.91        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000